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- Title
Reply to "Missed opportunities in large scale comparison of QSAR and conformal prediction methods and their applications in drug discovery".
- Authors
Bosc, Nicolas; Atkinson, Francis; Félix, Eloy; Gaulton, Anna; Hersey, Anne; Leach, Andrew R.
- Abstract
In response to Krstajic's letter to the editor concerning our published paper, we here take the opportunity to reply, to re-iterate that no errors in our work were identified, to provide further details, and to re-emphasise the outputs of our study. Moreover, we highlight that all of the data are freely available for the wider scientific community (including the aforementioned correspondent) to undertake follow-on studies and comparisons.
- Subjects
SCIENTIFIC community
- Publication
Journal of Cheminformatics, 2019, Vol 11, Issue 1, pN.PAG
- ISSN
1758-2946
- Publication type
Letter
- DOI
10.1186/s13321-019-0388-x